2-[[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-methyl-amino]acetic acid CAS Name: 2-[[1-(2-methoxyethyl)-5-benzotriazolyl]sulfonyl-methylamino]acetic acid IUPAC Name: 2-[[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-methylamino]acetic acid Traditional Name: 2-[[1-(2-methoxyethyl)benzotriazol-5-yl]sulfonyl-methyl-amino]acetic acid Formula: C12H16N4O5S MolecularWeight: 328.34424

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)N(N=N2)CCOC

Isomeric SMILES

CN(CC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)N(N=N2)CCOC

InChI

InChI=1S/C12H16N4O5S/c1-15(8-12(17)18)22(19,20)9-3-4-11-10(7-9)13-14-16(11)5-6-21-2/h3-4,7H,5-6,8H2,1-2H3,(H,17,18)